2,4-Diphenyl-1,3,5-triazine
Basic information
- CAS
1898-74-4- Standard SMILES
c1ccc(-c2ncnc(-c3ccccc3)n2)cc1- InChIKey
OTJZMNIBLUCUJZ-UHFFFAOYSA-N- Molecular formula
- C15H11N3
- Average molar mass
- 233.27 g/mol
- Monoisotopic mass
- 233.09529736
Names & identifiers
- Preferred name
- 2,4-Diphenyl-1,3,5-triazine
- IUPAC
- 2,4-diphenyl-1,3,5-triazine
- English name
- 2,4-diphenyl-1,3,5-triazine
- Molecular formula
- C15H11N3
- Molecular weight
- 233.27
Names & synonyms
2,4-diphenyl-1,3,5-triazine1898-74-4DTXSID40274561RefChem:246697DTXCID70226033Diphenyl-sym-TriazinMFCD00496783diphenyl-1,3,5-triazineSCHEMBL56387SCHEMBL18707724,6-diphenyl-1,3,5-triazineOTJZMNIBLUCUJZ-UHFFFAOYSA-N
Show more names
RMA-4151,3,5-Triazine, 2,4-diphenyl-
SY264809H56749AF-962/31929002F568688
Database identifiers
- CAS
1898-74-4- PubChem CID
- 15912
- DTXSID
DTXSID40274561- Nikkaji
- J1.552.729C
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 220
Physicochemical properties
- Melting point
- 76 · 76-77 °C(Solv: ethanol (64-17-5))
- Boiling point
- 448.8 · 448.8±28.0 °C(Predicted)
- Density
- 1.168 · 1.168±0.06 g/cm3(Predicted)
- pka
- 1.3 · 1.30±0.10(Predicted)
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Related reactions
3 records
Compound notes
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